Hydrochloric Acid → 4-(Benzyloxy)-2-methylbenzoic acid

HRID 2160373Notes

Reaction equation

HRID 2160373 reaction equation
[CH2:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[O:8][c:9]1[cH:10][c:11]([CH3:17])[c:12]([CH:13]=[O:14])[cH:15][cH:16]1.[CH2:40]1[O:41][CH2:42][CH2:43][O:44][CH2:45]1.[Cl+:29]([O-:30])[O-:31].[ClH:39].[NH2:24][S:25](=[O:26])(=[O:27])[OH:28].[Na+:23].[Na+:32].[Na+:37].[Na+:38].[OH2:46].[P:18](=[O:19])([O-:20])([OH:21])[OH:22].[S:33]([O-:34])([O-:35])=[O:36]>>[CH2:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[O:8][c:9]1[cH:10][c:11]([CH3:17])[c:12]([C:13](=[O:14])[OH:19])[cH:15][cH:16]1

Participants

10

Reactant 9

HCID 313Hydrochloric AcidHCID 923Sodium ion4×HCID 962WaterHCID 1003DihydrogenphosphateHCID 1099SulfiteHCID 5987Sulfamic AcidHCID 312751,4-DioxaneHCID 197148ChloriteHCID 27598062-Methyl 4-benzyloxybenzaldehyde

Product 1

HCID 211943914-(Benzyloxy)-2-methylbenzoic acid

Sources & evidence

ORD record
ord-6573634fb9c04f4baa0835178fe53cb4
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (4/10)

Reaction notes

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